SCHEMBL4608155

SCHEMBL4608155

COc1nc(N(C)C2CCN(C)C2)nc(OC)c1N

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 5/20 0.37
EHMT1 Q9H9B1 5/20 0.37
NMT1 P30419 5/20 0.36
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
JAK3 P52333 1/20 0.35
SLC2A1 P11166 1/20 0.34
NSD2 O96028 1/20 0.33
ROCK2 O75116 1/20 0.33
MCHR1 Q99705 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PIK3CD O00329 2/20 0.31
PIK3R1 P27986 2/20 0.31
PIK3CA P42336 2/20 0.31
PIK3CB P42338 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4608577 0.80 ALDH1A1 (0.36) EHMT2EHMT1NMT1JAK2JAK1
SCHEMBL24074322 0.76 JAK2 (0.46) JAK2JAK1JAK3NSD2ROCK2
SCHEMBL6208888 0.70 NMT1 (0.45) EHMT2EHMT1NMT1SLC2A1NSD2
SCHEMBL4609021 0.70 MAP4K4 (0.41) ROCK2
SCHEMBL13743574 0.69 CCR4 (0.44) EHMT2ROCK2HTR2C
SCHEMBL3565009 0.65 CTSL (0.40) JAK2JAK1JAK3MCHR1ALDH1A1
SCHEMBL14384741 0.63
SCHEMBL13178388 0.63
SCHEMBL172592 0.62
SCHEMBL81996 0.62

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080261918-A1 Silicon Compounds and Their Use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-10-23 US disclosed
EP-1824863-B1 SILICON COMPOUNDS AND THEIR USE TAKEDA CAMBRIDGE LTD (GB) 2008-10-08 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080261918-A1 Silicon Compounds and Their Use SOST, SIK2, SCLY EHMT2 1575/4885EHMT1 1567/4885NMT1 2852/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.